| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 13th, 2010 | 18 | Yes |
Popular Name: 3-[(4-amino-2-bromo-phenyl)methyl-isobutyl-amino]propanenitrile 3-[(4-amino-2-bromo-phenyl)methy…
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 2.13 | 8.01 | -42.28 | 3 | 3 | 1 | 54 | 311.247 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.13 | 6.93 | -6.36 | 2 | 3 | 0 | 53 | 310.239 | 6 | ↓ |
